N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide

C11H12N4O3S — CID 47182407

IUPACN-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCN(C(=O)Cn1ccc(=O)n(C)c1=O)c1nccs1
InChIInChI=1S/C11H12N4O3S/c1-13(10-12-4-6-19-10)9(17)7-15-5-3-8(16)14(2)11(15)18/h3-6H,7H2,1-2H3
InChIKeyDBSCIVCIZIJARQ-UHFFFAOYSA-N
MW280.31 g/mol
LogP-0.33
Rot. Bonds3

About N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide

N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 47182407) has the molecular formula C11H12N4O3S and a molecular weight of 280.31 g/mol. Its IUPAC name is N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID47182407
Molecular FormulaC11H12N4O3S
Molecular Weight280.31 g/mol
Exact Mass280.06
IUPAC NameN-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCN(C(=O)Cn1ccc(=O)n(C)c1=O)c1nccs1
InChIInChI=1S/C11H12N4O3S/c1-13(10-12-4-6-19-10)9(17)7-15-5-3-8(16)14(2)11(15)18/h3-6H,7H2,1-2H3
InChIKeyDBSCIVCIZIJARQ-UHFFFAOYSA-N
XLogP-0.33
TPSA77.20 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 5-0.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide (CID 47182407) is N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide is CN(C(=O)Cn1ccc(=O)n(C)c1=O)c1nccs1.
What is the InChIKey of N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is DBSCIVCIZIJARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3S/c1-13(10-12-4-6-19-10)9(17)7-15-5-3-8(16)14(2)11(15)18/h3-6H,7H2,1-2H3.
What are the key properties of N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide?
N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 280.31 g/mol, XLogP of -0.33, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 47182407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).